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4-[6,6-dimethyl-4-oxo-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]-2-{[(1r,4r)-4-hydroxycyclohexyl]amino}benzamide

Compound number:
MolPort-023-219-207
CAS number: 908112-43-6; 908112-43-6
IUPAC:
4-[6,6-dimethyl-4-oxo-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]-2-{[(1r,4r)-4-hydroxycyclohexyl]amino}benzamide
IUPAC traditional:
4-[6,6-dimethyl-4-oxo-3-(trifluoromethyl)-5,7-dihydroindazol-1-yl]-2-{[(1r,4r)-4-hydroxycyclohexyl]amino}benzamide
SMILES:
CC1(C)Cc2c(c(nn2-c2ccc(C(N)=O)c(N[C@H]3CC[C@H](O)CC3)c2)C(F)(F)F)C(=O)C1 |r,wU:18.18,wD:21.22,(8.5,3.61,;6.99,3.29,;8.08,2.2,;5.96,4.44,;4.45,4.12,;3.98,2.65,;2.44,2.65,;1.96,4.12,;3.21,5.02,;3.21,6.56,;1.87,7.33,;1.87,8.87,;3.21,9.64,;3.21,11.18,;1.87,11.95,;4.54,11.95,;4.54,8.87,;5.87,9.64,;7.21,8.87,;8.54,9.64,;9.88,8.87,;9.88,7.33,;11.21,6.56,;8.54,6.56,;7.21,7.33,;4.54,7.33,;1.53,1.41,;2.16,,;,1.57,;.91,2.81,;5.01,1.51,;4.53,.04,;6.51,1.83,)|
InChI key:
ZFVRYNYOPQZKDG-MQMHXKEQSA-N
Molecular formula: C23H27F3N4O3
Molecular weight: 464.489

Marketplace Offers

Price range: from to USD Pack size: from to mg
In warehouse: from to mg Lead time: from to days
S&H to USA: 40.00 USD
S&H to World: 100.00 USD

Supplier Catalogue Data


Catalog: Screening compound Ships out: 7 business days Purity: n/a
Last updated: > 3 months ago In warehouse: Unverified Salt: Free Base
Pack size Ships out Price Qty
5 mg March 5, 2018 348.30 USD
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10 mg March 5, 2018 477.30 USD
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50 mg March 5, 2018 1251.30 USD
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S&H to USA: 50.00 USD
S&H to World: 50.00 USD

Supplier Catalogue Data


Catalog: Screening compound Ships out: 7 business days Purity: 0.99
Last updated: last month In warehouse: Unverified
Pack size Ships out Price Qty
2 mg March 5, 2018 115.00 USD
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5 mg March 5, 2018 218.00 USD
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10 mg March 5, 2018 298.00 USD
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S&H to USA: 58.00 USD
S&H to World: 105.00 USD

Supplier Catalogue Data


Catalog: Building blocks Ships out: 10 business days Purity: 98+%
Last updated: > 3 months ago In warehouse: 1.29 g
Pack size Ships out Price Qty
5 mg March 8, 2018 139.00 USD
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10 mg March 8, 2018 191.00 USD
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50 mg March 8, 2018 500.00 USD
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S&H to USA: 80.00 USD
S&H to World: 95.00 USD

Supplier Catalogue Data


Catalog: Building blocks Ships out: 10 business days Purity: 98+%
Last updated: > 3 months ago In warehouse: 300.00 mg
Pack size Ships out Price Qty
5 mg March 8, 2018 139.00 USD
ADD TO CART
10 mg March 8, 2018 191.00 USD
ADD TO CART
50 mg March 8, 2018 500.00 USD
ADD TO CART
S&H to USA: 80.00 USD
S&H to World: 100.00 USD

Supplier Catalogue Data


Catalog: Building blocks Ships out: 10 business days Purity: 98+%
Last updated: > 3 months ago In warehouse: Unverified
Pack size Ships out Price Qty
5 mg March 8, 2018 299.00 USD
ADD TO CART
10 mg March 8, 2018 387.00 USD
ADD TO CART
50 mg March 8, 2018 908.00 USD
ADD TO CART

More Information

Compound Identifiers
Compound number: MolPort-023-219-207
CAS number: 908112-43-6; 908112-43-6

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000036741071
ZINC000100015966
ZINC000102249129
MFCD16038907
2-[(trans-4-hydroxycyclohexyl)amino]-4-[4,5,6,7-tetrahydro-6,6-dimethyl-4-oxo-3-(trifluoromethyl)-1H-indazol-1-yl]-benzamide
4-(6,6-dimethyl-4-oxo-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl)-2-(((1r,4r)-4-hydroxycyclohexyl)amino)benzamide
SNX-2112
SNX-2112 (PF-04928473)

InChI
InChI: 1S/C23H27F3N4O3/c1-22(2)10-17-19(18(32)11-22)20(23(24,25)26)29-30(17)13-5-8-15(21(27)33)16(9-13)28-12-3-6-14(31)7-4-12/h5,8-9,12,14,28,31H,3-4,6-7,10-11H2,1-2H3,(H2,27,33)/t12-,14-
InChI key: ZFVRYNYOPQZKDG-MQMHXKEQSA-N

Calculated Properties
Molecular formula: C23H27F3N4O3
Molecular weight: 464.489

Other

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2018 MolPort, v2.37, release date 05-02-2018 19:00 (+0200). All rights reserved.